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SCHEMBL14766285

SCHEMBL14766285

C=CCCOc1ccc(-c2ccc(CCc3ccc(C4CCC(OCC)CC4)c(F)c3F)cc2)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 2/20 0.35
▸ S1PR1 P21453 2/20 0.34
▸ S1PR3 Q99500 2/20 0.34
▸ GABRA1 P14867 1/20 0.33
▸ GABRB2 P47870 1/20 0.33
▸ NR1H4 Q96RI1 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14765960 0.94 S1PR1 (0.38) FFAR4S1PR1S1PR3GABRA1GABRB2
SCHEMBL14766570 0.94 FFAR4 (0.35) FFAR4S1PR1S1PR3GABRA1GABRB2
SCHEMBL14765945 0.92 S1PR1 (0.39) FFAR4S1PR1S1PR3GABRA1GABRB2
SCHEMBL14765739 0.92 FFAR4 (0.36) FFAR4S1PR1S1PR3GABRA1GABRB2
SCHEMBL12735507 0.91 FFAR4 (0.36) FFAR4S1PR1S1PR3NR1H4
SCHEMBL14766524 0.90 FFAR4 (0.36) FFAR4GABRA1GABRB2NR1H4
SCHEMBL14765740 0.90 FFAR4 (0.39) FFAR4S1PR1S1PR3NR1H4
SCHEMBL14766879 0.89 FFAR4 (0.36) FFAR4S1PR1S1PR3GABRA1GABRB2
SCHEMBL12735514 0.88 FFAR4 (0.37) FFAR4S1PR1S1PR3NR1H4
SCHEMBL14766821 0.88 GABRA1 (0.36) FFAR4GABRA1GABRB2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 — — US disclosed